Vitas-M small molecule compound
[3-(1,3-benzothiazol-2-yl)piperidin-1-yl](6-fluoro-1H-indol-3-yl)acetic acid
Catalog ID
STL235976
SMILES Fc1ccc2c(c1)[nH]cc2C(N1CCCC(C1)c1nc2c(s1)cccc2)C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H20FN3O2S MW 409.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN3O2S/c23-14-7-8-15-16(11-24-18(15)10-14)20(22(27)28)26-9-3-4-13(12-26)21-25-17-5-1-2-6-19(17)29-21/h1-2,5-8,10-11,13,20,24H,3-4,9,12H2,(H,27,28)InChIKey
BUFRXMXROUJKMO-UHFFFAOYSA-NSynonyms
1081132-56-0(3(13benzothiazol2yl)piperidin1yl)(6fluoro1Hindol3yl)aceticacid
1081132560
2(3(13benzothiazol2yl)piperidin1yl)2(6fluoro1Hindol3yl)aceticacid
2(3(benzo(d)thiazol2yl)piperidin1yl)2(6fluoro1Hindol3yl)aceticacid
C1CC(CN(C1)C(C2=CNC3=C2C=CC(=C3)F)C(=O)O)C4=NC5=CC=CC=C5S4
Fc1ccc2c(c1)(nH)cc2C(N1CCCC(C1)c1nc2c(s1)cccc2)C(=O)O
InChI=1SC22H20FN3O2Sc2314781516(112418(15)1014)20(22(27)28)2693413(1226)212517512619(17)2921h12581011132024H34912H2(H2728)
MFCD12205584
ZINC000020716778
ZINC000104822531
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